List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
216273 |
85085973 |
1 |
O3C15H20 |
A3B15C20 |
-106.73 |
7.08 |
-9.85 |
-0.32 |
0 |
|
|
216274 |
85085974 |
1 |
O3C15H20 |
A3B15C20 |
-27.69 |
6.36 |
-9.66 |
-0.52 |
0 |
|
|
216275 |
85085975 |
2 |
NOC7H10 |
ABC7D10 |
-67.18 |
2.2 |
-9.16 |
0.21 |
0 |
|
|
216276 |
85085976 |
1 |
OSN2C13H16 |
ABC2D13E16 |
-23.61 |
3.87 |
-8.85 |
-0.35 |
0 |
|
|
216277 |
85085977 |
1 |
OSiC15H24 |
ABC15D24 |
-56.91 |
2.06 |
-9.45 |
0.17 |
0 |
|
|
216278 |
85085978 |
1 |
ClOC15H17 |
ABC15D17 |
-10.39 |
4.06 |
-9.44 |
-0.47 |
0 |
|
|
216279 |
85085979 |
1 |
OSnC8H18 |
ABC8D18 |
-43.58 |
2.41 |
-9.44 |
1.07 |
0 |
|
|
216280 |
85085980 |
1 |
BrO2C10H17 |
AB2C10D17 |
-126.07 |
2.06 |
-10.08 |
-0.25 |
0 |
|
|
216281 |
85085983 |
1 |
NO2H11C16 |
AB2C11D16 |
95.02 |
7.22 |
-9.32 |
-1.62 |
0 |
|
|
216282 |
85085984 |
1 |
SO2N3C11H11 |
AB2C3D11E11 |
-19.47 |
5.24 |
-8.65 |
-1.24 |
0 |
|
|
216283 |
85085985 |
1 |
NO3C14H19 |
AB3C14D19 |
-132.7 |
6.54 |
-8.74 |
0.11 |
0 |
|
|
216284 |
85085987 |
1 |
OSN3C12H15 |
ABC3D12E15 |
45.31 |
5.11 |
-8.45 |
-0.84 |
0 |
|
|
216285 |
85085988 |
1 |
NSO3C11H23 |
ABC3D11E23 |
-167.65 |
4.54 |
-8.79 |
0.54 |
0 |
|
|
216286 |
85085989 |
1 |
NOSC14H19 |
ABCD14E19 |
-21.12 |
0.54 |
-8.58 |
-0.19 |
0 |
|
|
216287 |
85085990 |
1 |
O5C13H14 |
A5B13C14 |
-180.51 |
5.43 |
-10.05 |
-0.71 |
0 |
|
|
216288 |
85085991 |
1 |
ON4C14H16 |
AB4C14D16 |
37.85 |
8.34 |
-8.78 |
-0.17 |
0 |
|
|
216289 |
85085992 |
1 |
SO2N4C10H10 |
AB2C4D10E10 |
-7.92 |
5.71 |
-8.8 |
-1.34 |
0 |
|
|
216290 |
85085995 |
2 |
O2C7H9 |
A2B7C9 |
-143.06 |
5.69 |
-8.99 |
0.06 |
0 |
|
|
216291 |
85085998 |
2 |
ON2C6H9 |
AB2C6D9 |
-51.98 |
8.85 |
-9.72 |
-1.23 |
0 |
|
|
216292 |
85086000 |
1 |
O3C15H22 |
A3B15C22 |
-115.92 |
5.99 |
-9.78 |
0.01 |
0 |
|
|
216293 |
85086002 |
2 |
NOC7H11 |
ABC7D11 |
-95.73 |
2.65 |
-9.03 |
-0.08 |
1 |
|
|
216294 |
85086005 |
1 |
ClFO3N4C7H9 |
ABC3D4E7F9 |
-139.57 |
3.64 |
0.0 |
0.0 |
0 |
|
|
216295 |
85086006 |
1 |
Cl2O4H8C9 |
A2B4C8D9 |
-153.98 |
6.34 |
-10.28 |
-1.66 |
0 |
|
|
216296 |
85086007 |
1 |
NC8O8H13 |
AB8C8D13 |
-347.96 |
3.89 |
-10.73 |
-0.55 |
1 |
|
|
216297 |
85086011 |
1 |
O2N5C11H16 |
A2B5C11D16 |
-26.91 |
3.5 |
0.0 |
0.0 |
0 |